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405-79-8,MFCD00004304
Catalog No.:AA003LD2

405-79-8 | 4-Fluorophenoxyacetic acid

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5g
98%
in stock  
$15.00   $11.00
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25g
98%
in stock  
$18.00   $13.00
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100g
98%
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$58.00   $41.00
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA003LD2
Chemical Name:
4-Fluorophenoxyacetic acid
CAS Number:
405-79-8
Molecular Formula:
C8H7FO3
Molecular Weight:
170.1378
MDL Number:
MFCD00004304
SMILES:
OC(=O)COc1ccc(cc1)F
NSC Number:
49589
Properties
Properties
 
BP:
295.2°C at 760 mmHg  
Form:
Solid  
MP:
104-104.5 °C  
Storage:
Keep in dry area;Room Temperature;  

Computed Properties
 
Complexity:
152  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
3  
XLogP3:
1.6  

Downstream Synthesis Route

[1]ZhurnalObshcheiKhimii,1959,vol.29,p.3708;engl.Ausg.S.3664

[1]JournalofMedicinalChemistry,2013,vol.56,p.3783-3805

[2]Phosphorus,SulfurandSiliconandtheRelatedElements,2006,vol.181,p.2135-2145

[3]JournaloftheAmericanChemicalSociety,1955,vol.77,p.3924

[4]JournalofMedicinalChemistry,1996,vol.39,p.1039-1048

[5]JournalofMedicinalChemistry,2004,vol.47,p.2157-2165

[6]Tetrahedron,2004,vol.60,p.12231-12237

[7]Patent:US4620867,1986,A

[8]Patent:US4479900,1984,A

[9]Patent:WO2007/97871,2007,A2.Locationinpatent:Page/Pagecolumn14

[10]EuropeanJournalofMedicinalChemistry,2009,vol.44,p.4726-4733

[11]JournalofMedicinalChemistry,2010,vol.53,p.2038-2050

[12]JournalofFluorineChemistry,2012,vol.142,p.24-28

[13]Phosphorus,SulfurandSiliconandtheRelatedElements,2013,vol.188,p.663-671

[14]JournalofHeterocyclicChemistry,2015,vol.52,p.173-179

[15]JournalofHeterocyclicChemistry,2016,vol.53,p.183-187

[16]JournalofHeterocyclicChemistry,2017,vol.54,p.1506-1513

[17]BioorganicandMedicinalChemistryLetters,2017,vol.27,p.3931-3938

[1]ZhurnalObshcheiKhimii,1959,vol.29,p.3708;engl.Ausg.S.3664

[2]Patent:US4170597,1979,A

[3]Patent:US4085272,1978,A

[1]JournaloftheAmericanChemicalSociety,1959,vol.81,p.94,95,97

[1]ZhurnalObshcheiKhimii,1959,vol.29,p.3708;engl.Ausg.S.3664

[2]JournaloftheAmericanChemicalSociety,1959,vol.81,p.94,95,97

Literature

Title: Burton R. Anderson. et al. Control of Annual Bluegrass and Crabgrass in Turf with Fluorophenoxyacetic Acids. Weed Science. January 1958 , pp. 52-58.

Title: Wanwan Wang, et al. Induction of Defense in Cereals by 4-fluorophenoxyacetic Acid Suppresses Insect Pest Populations and Increases Crop Yields in the Field. Proc Natl Acad Sci U S A. 2020 Jun 2;117(22):12017-12028.

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SDS
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